KAEMPFEROL-3-O-(6'''-TRANS-P-COUMAROYL-2''-GLUCOSYL)RHAMNOSIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C36H36O17
Molecular Weight	740.6608
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of KAEMPFEROL-3-O-(6'''-TRANS-P-COUMAROYL-2''-GLUCOSYL)RHAMNOSIDE

Structure Search

SMILES

C[C@@H]1O[C@@H](OC2=C(OC3=C(C2=O)C(O)=CC(O)=C3)C4=CC=C(O)C=C4)[C@H](O[C@@H]5O[C@H](COC(=O)\C=C\C6=CC=C(O)C=C6)[C@@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]1O

InChI

InChIKey=KAJMZANRKFVVKV-RGXKZFLBSA-N

InChI=1S/C36H36O17/c1-15-26(42)30(46)34(53-35-31(47)29(45)27(43)23(51-35)14-48-24(41)11-4-16-2-7-18(37)8-3-16)36(49-15)52-33-28(44)25-21(40)12-20(39)13-22(25)50-32(33)17-5-9-19(38)10-6-17/h2-13,15,23,26-27,29-31,34-40,42-43,45-47H,14H2,1H3/b11-4+/t15-,23+,26-,27+,29-,30+,31+,34+,35-,36-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C36H36O17
Molecular Weight	740.6608
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:09:54 GMT 2025` Edited by `admin` on `Mon Mar 31 22:09:54 GMT 2025`
Record UNII	7NMJ4SI4P6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

KAEMPFEROL-3-O-(6'''-TRANS-P-COUMAROYL-2''-GLUCOSYL)RHAMNOSIDE (CONSTITUENT OF GINKGO) [DSC]

Preferred Name

English

KAEMPFEROL-3-O-(6'''-TRANS-P-COUMAROYL-2''-GLUCOSYL)RHAMNOSIDE

Common Name

English

4H-1-BENZOPYRAN-4-ONE, 3-((6-DEOXY-2-O-(6-O-((2E)-3-(4-HYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL)-.BETA.-D-GLUCOPYRANOSYL)-.ALPHA.-L-MANNOPYRANOSYL)OXY)-5,7-DIHYDROXY-2-(4-HYDROXYPHENYL)-

Systematic Name

English

Code System Code Type Description

CAS

111957-48-3

Created by admin on Mon Mar 31 22:09:54 GMT 2025 , Edited by admin on Mon Mar 31 22:09:54 GMT 2025

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PUBCHEM

11664897

Created by admin on Mon Mar 31 22:09:54 GMT 2025 , Edited by admin on Mon Mar 31 22:09:54 GMT 2025

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FDA UNII

7NMJ4SI4P6

Created by admin on Mon Mar 31 22:09:54 GMT 2025 , Edited by admin on Mon Mar 31 22:09:54 GMT 2025

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EPA CompTox

DTXSID001099303

Created by admin on Mon Mar 31 22:09:54 GMT 2025 , Edited by admin on Mon Mar 31 22:09:54 GMT 2025

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